3-methyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)-2-thenoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CSC3=C2CCCC3)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CSC3=C2CCCC3)C(=O)O

InChI

InChI=1S/C15H15NO3S2/c1-8-6-12(21-13(8)15(18)19)16-14(17)10-7-20-11-5-3-2-4-9(10)11/h6-7H,2-5H2,1H3,(H,16,17)(H,18,19)